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3,7-Tetramethylenetricyclo[3.3.0.0(3,7)]octane-1,5-diol
SpectraBase Compound ID Jhrv3yLL2G9
InChI InChI=1S/C12H18O2/c13-11-5-9-3-1-2-4-10(9,7-11)8-12(11,14)6-9/h13-14H,1-8H2/t9?,10?,11-,12+
InChIKey USXIRAFVNMTPGX-CAODYFQJSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9UmzSn68CHE
Name 3,7-Tetramethylenetricyclo[3.3.0.0(3,7)]octane-1,5-diol
Alternate Name(s) Tetracyclo[6.2.1.1(6,9).0(1,6)]dodecane-8,9-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c13-11-5-9-3-1-2-4-10(9,7-11)8-12(11,14)6-9/h13-14H,1-8H2/t9?,10?,11-,12+
InChIKey USXIRAFVNMTPGX-CAODYFQJSA-N
Molecular Weight 194.274 g/mol
SMILES O[C@]12[C@]3(CC4(C2)CCCCC4(C3)C1)O
SPLASH splash10-0a4u-5900000000-5482fd9d4667ae03f877
Source of Spectrum SK-25-1291-2
Wiley ID 866751